Geometry & MOs

Info

ID:	422917
PubChem CID:	135118611
Reduced:	ClN2O4C25H27 (1)
Stoich.:	AB2C4D25E27 (1)
Weight, g/mol:	364.105705
ΔH_f, kcal/mol:	-143.64
Dipole, Da:	3.56
IP(EA), eV:	-8.72(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-difluorophenyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-carboxamide

Drug info:

PubChemData

Smile

C[C@@]1(CC2(CCN(CC2)C(=O)C3=C(C4=C(N3)C=CC(=C4)Cl)C5=CC=CC=C5)OC[C@@H]1O)O

DOS

IR

Vibrations